SCHEMBL4160606

SCHEMBL4160606

CCCCNC(=O)C#CC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 5/20 0.48
ACHE P22303 8/20 0.45
MMP2 P08253 2/20 0.45
ALOX15 P16050 1/20 0.43
NAAA Q02083 1/20 0.42
TSHR P16473 1/20 0.41
HTT P42858 1/20 0.41
MMP1 P03956 1/20 0.41
CASP2 P42575 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11129643 0.80 EPHX1 (0.50) EPHX1ACHEMMP2NAAATSHR
SCHEMBL4165282 0.79 MCL1 (0.38) EPHX1MMP2MMP1
SCHEMBL8950790 0.78 EPHX1 (0.48) EPHX1ACHEMMP2NAAATSHR
SCHEMBL8950824 0.78 EPHX1 (0.48) EPHX1ACHEMMP2NAAATSHR
SCHEMBL9165872 0.78 EPHX1 (0.48) EPHX1ACHEMMP2NAAATSHR
SCHEMBL14873899 0.77 EPHX1 (0.47) EPHX1ACHEMMP2ALOX15NAAA
SCHEMBL4164892 0.75 TSHR (0.47) TSHRHTT
SCHEMBL5524972 0.75
SCHEMBL14873909 0.74 EPHX1 (0.56) EPHX1NAAACASP2
SCHEMBL42439 0.74

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090247680-A1 ADHESION PROMOTING ADDITIVE AVERY DENNISON CORPORATION (US) 2009-10-01 US disclosed
EP-2024440-A2 ADHESION PROMOTING ADDITIVE AVERY DENNISON CORPORATION (US) 2009-02-18 EP disclosed
WO-2007146603-A2 ADHESION PROMOTING ADDITIVE AVERY DENNISON CORPORATION (US) 2007-12-21 WO disclosed
EP-0140530-B1 LATENTLY-CURABLE ORGANOSILICONE RELEASE COATING COMPOSITION MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1989-03-08 EP disclosed
US-4533575-A ETHYLENICALLY UNSATURATED POLYSILOXANE AND POLYHYDROSILOXANE MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1985-08-06 US disclosed
EP-0140530-A1 Latently-curable organosilicone release coating composition MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1985-05-08 EP disclosed
US-4504645-A GELATION INHIBITION USING A MONOESTER OR -AMIDE OF AN UNSATURATED DICARBOXYLIC ACID; SHELF LIFE; HEAT CURING MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1985-03-12 US disclosed